Toluene → HCID 12073916, compound

HRID 1561672Notes

Reaction equation

HRID 1561672 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([O:18][CH2:19][CH2:20][CH2:21][CH3:22])[c:7]([CH:15]([CH3:16])[OH:17])[cH:8][c:9]([C:11]([CH3:12])([CH3:13])[CH3:14])[cH:10]1.[CH3:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([O:18][CH2:19][CH2:20][CH2:21][CH3:22])[c:7]([C:15]([CH3:16])=[O:17])[cH:8][c:9]([C:11]([CH3:12])([CH3:13])[CH3:14])[cH:10]1

Participants

3

Sources & evidence

ORD record
ord-243d2822b9a9499d85cc014deec6e58d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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